methyl (3S,4S,5S,6S)-6-acetyloxy-3,4,5-tris(oxidanyl)cyclohexene-1-carboxylate

Systemtic Name: methyl (3S,4S,5S,6S)-6-acetyloxy-3,4,5-tris(oxidanyl)cyclohexene-1-carboxylate Openeye Name: methyl (3S,4S,5S,6S)-6-acetoxy-3,4,5-trihydroxy-cyclohexene-1-carboxylate CAS Name: (3S,4S,5S,6S)-6-acetyloxy-3,4,5-trihydroxy-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (3S,4S,5S,6S)-6-acetyloxy-3,4,5-trihydroxycyclohexene-1-carboxylate Traditional Name: (3S,4S,5S,6S)-6-acetoxy-3,4,5-trihydroxy-cyclohexene-1-carboxylic acid methyl ester Formula: C10H14O7 MolecularWeight: 246.21396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(C=C1C(=O)OC)O)O)O

Isomeric SMILES

CC(=O)O[C@@H]1[C@H]([C@H]([C@H](C=C1C(=O)OC)O)O)O

InChI

InChI=1S/C10H14O7/c1-4(11)17-9-5(10(15)16-2)3-6(12)7(13)8(9)14/h3,6-9,12-14H,1-2H3/t6-,7-,8-,9-/m0/s1